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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	24-Jun-2025	/bis-PEtAm2 bis-PEtAm2_Ci_1_PPrelaxedscan_5	Pye, Cory	Gaussian; 03; AM64L-G03RevD.02	Single point Structure	-	-	-651.648843312; Eh
	24-Jun-2025	/bis-PEtAm2 bis-PEtAm2_Ci_1_PPrelaxedscan_6	Pye, Cory	Gaussian; 03; AM64L-G03RevD.02	Single point Structure	-	-	-1061.29790858; Eh
	24-Jun-2025	/bis-PEtAm2Ph2 bis-PEtAm2Ph2_Ci_1_2	Pye, Cory	Gaussian; 03; AM64L-G03RevD.02	Geometry optimization Minimum	RHF; RB3LYP	STO-3G 3-21G 6-31G(D) 6-31+G(D)	178.80190312; Eh
	24-Jun-2025	/bis-PEtAm2Ph2 bis-PEtAm2Ph2_Ci_2_2	Pye, Cory	Gaussian; 03; AM64L-G03RevD.02	Geometry optimization Minimum	RHF; RB3LYP	STO-3G 3-21G 6-31G(D) 6-31+G(D)	181.93997543; Eh
	24-Jun-2025	/PEtAm2Ph2iPr4_doublet PEtAm2Ph2iPr4_C2_2	Pye, Cory	Gaussian; 03; AM64L-G03RevD.02	Geometry optimization Minimum	UHF	STO-3G	-64.31980235; Eh
	28-Jan-2026	E4	Garcia Padilla, Eduardo	Orca; 6.1.x; STABLE	Geometry optimization Minimum	DFT	def2-tzvp(-f); def2/J; def2-TZVP	-1398.90963990940713; Eh
	28-Jan-2026	E3	Garcia Padilla, Eduardo	Orca; 6.1.x; STABLE	Geometry optimization Minimum	DFT	def2-tzvp(-f); def2/J; def2-TZVP	-1398.90906144984524; Eh
	28-Jan-2026	E5	Garcia Padilla, Eduardo	Orca; 6.1.x; STABLE	Geometry optimization Minimum	DFT	def2-tzvp(-f); def2/J; def2-TZVP	-1136.95868835721126; Eh
	24-Jun-2025	/PEtAm2Ph2iPr4_doublet PEtAm2Ph2iPr4_C2_1	Pye, Cory	Gaussian; 03; AM64L-G03RevD.02	Single point Structure	-	-	-1439.16378487; Eh
	24-Jun-2025	/bis-PEtAm2Ph2 bis-PEtAm2Ph2_Ci_1_1	Pye, Cory	Gaussian; 03; AM64L-G03RevD.02	Single point Structure	-	-	-1952.48882392; Eh

Results 381041-381050 of 402241 (Search time: 0.191 seconds).